[gmx-users] combining minimization and md

Jack Shultz js at drugdiscoveryathome.com
Wed Dec 9 18:57:57 CET 2009

I was wondering, is there a way you can prepare the parameter files so
it will do a minimization followed by molecular dynamics? I think its
a feature some other Molecular Dynamics apps support but I have not
seen any example mdp files that describe this.



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